In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: 4-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridin-2-amine 4-(aminomethyl)-N-methyl-N-(4-me…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.95 | 5.97 | -48.37 | 3 | 3 | 1 | 44 | 234.367 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 5.58 | -4.42 | 2 | 3 | 0 | 42 | 233.359 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 6.27 | -25.99 | 3 | 3 | 1 | 43 | 234.367 | 3 | ↓ |